3-(2-chlorophenyl)-4-(2-fluorophenyl)-5-{[(4-methoxyphenyl)methyl]sulfanyl}-4H-1,2,4-triazole
Chemical Structure Depiction of
3-(2-chlorophenyl)-4-(2-fluorophenyl)-5-{[(4-methoxyphenyl)methyl]sulfanyl}-4H-1,2,4-triazole
3-(2-chlorophenyl)-4-(2-fluorophenyl)-5-{[(4-methoxyphenyl)methyl]sulfanyl}-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | V010-9269 |
| Compound Name: | 3-(2-chlorophenyl)-4-(2-fluorophenyl)-5-{[(4-methoxyphenyl)methyl]sulfanyl}-4H-1,2,4-triazole |
| Molecular Weight: | 425.91 |
| Molecular Formula: | C22 H17 Cl F N3 O S |
| Salt: | not_available |
| Smiles: | COc1ccc(CSc2nnc(c3ccccc3[Cl])n2c2ccccc2F)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.2796 |
| logD: | 5.2796 |
| logSw: | -5.7373 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 31.955 |
| InChI Key: | MXWQPSGJGCNDMT-UHFFFAOYSA-N |